For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-[3,5-bis(2,2,2-trifluoroethoxy)phenyl]-1-methyl-4-nitro-1H-pyrazole-5-carboxamide
SpectraBase Compound ID FgY0hgMVuvT
InChI InChI=1S/C15H12F6N4O5/c1-24-12(11(5-22-24)25(27)28)13(26)23-8-2-9(29-6-14(16,17)18)4-10(3-8)30-7-15(19,20)21/h2-5H,6-7H2,1H3,(H,23,26)
InChIKey UCQNCDCZQZXZCH-UHFFFAOYSA-N
Mol Weight 442.27 g/mol
Molecular Formula C15H12F6N4O5
Exact Mass 442.071188 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 39wyBnltS54
Name 1H-pyrazole-5-carboxamide, N-[3,5-bis(2,2,2-trifluoroethoxy)phenyl]-1-methyl-4-nitro-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.071188475 u
Formula C15H12F6N4O5
InChI InChI=1S/C15H12F6N4O5/c1-24-12(11(5-22-24)25(27)28)13(26)23-8-2-9(29-6-14(16,17)18)4-10(3-8)30-7-15(19,20)21/h2-5H,6-7H2,1H3,(H,23,26)
InChIKey UCQNCDCZQZXZCH-UHFFFAOYSA-N
Molecular Weight 442.274 g/mol
NMR Offset 17.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_5262
Solvent DMSO-d6
Source Vendor ID: NMR/9313073; Lab Info: PNA; Lab Number: PNA-NA00780